8-phenyl-3-pyridin-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene

C19H20N2O — CID 11976180

IUPAC8-phenyl-3-pyridin-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene
SMILESc1ccc(C2CCC3(CC2)CC(c2ccccn2)=NO3)cc1
InChIInChI=1S/C19H20N2O/c1-2-6-15(7-3-1)16-9-11-19(12-10-16)14-18(21-22-19)17-8-4-5-13-20-17/h1-8,13,16H,9-12,14H2
InChIKeyNXFOLVWCPHKWQM-UHFFFAOYSA-N
MW292.38 g/mol
LogP4.30
Rot. Bonds2

About 8-phenyl-3-pyridin-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene

8-phenyl-3-pyridin-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene (PubChem CID 11976180) has the molecular formula C19H20N2O and a molecular weight of 292.38 g/mol. Its IUPAC name is 8-phenyl-3-pyridin-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene.

Molecular Properties

Compound Name8-phenyl-3-pyridin-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene
PubChem CID11976180
Molecular FormulaC19H20N2O
Molecular Weight292.38 g/mol
Exact Mass292.16
IUPAC Name8-phenyl-3-pyridin-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene
SMILESc1ccc(C2CCC3(CC2)CC(c2ccccn2)=NO3)cc1
InChIInChI=1S/C19H20N2O/c1-2-6-15(7-3-1)16-9-11-19(12-10-16)14-18(21-22-19)17-8-4-5-13-20-17/h1-8,13,16H,9-12,14H2
InChIKeyNXFOLVWCPHKWQM-UHFFFAOYSA-N
XLogP4.30
TPSA34.48 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-phenyl-3-pyridin-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene?
The IUPAC name of 8-phenyl-3-pyridin-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene (CID 11976180) is 8-phenyl-3-pyridin-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene.
What is the SMILES notation for 8-phenyl-3-pyridin-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene?
The canonical SMILES for 8-phenyl-3-pyridin-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene is c1ccc(C2CCC3(CC2)CC(c2ccccn2)=NO3)cc1.
What is the InChIKey of 8-phenyl-3-pyridin-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene?
The InChIKey is NXFOLVWCPHKWQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O/c1-2-6-15(7-3-1)16-9-11-19(12-10-16)14-18(21-22-19)17-8-4-5-13-20-17/h1-8,13,16H,9-12,14H2.
What are the key properties of 8-phenyl-3-pyridin-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene?
8-phenyl-3-pyridin-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene has a molecular weight of 292.38 g/mol, XLogP of 4.30, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-phenyl-3-pyridin-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene is sourced from PubChem (CID 11976180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).